N-[4-[6-(cyclohexylcarbonylamino)-1H-benzimidazol-3-ium-2-yl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[6-(cyclohexylcarbonylamino)-1H-benzimidazol-3-ium-2-yl]phenyl]cyclohexanecarboxamide Openeye Name: N-[4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-3-ium-2-yl]phenyl]cyclohexanecarboxamide CAS Name: N-[4-[6-[[cyclohexyl(oxo)methyl]amino]-1H-benzimidazol-3-ium-2-yl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-3-ium-2-yl]phenyl]cyclohexanecarboxamide Traditional Name: N-[4-[6-(cyclohexanecarbonylamino)-1H-benzimidazol-3-ium-2-yl]phenyl]cyclohexanecarboxamide Formula: C27H33N4O2+ MolecularWeight: 445.57652

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=[NH+]C4=C(N3)C=C(C=C4)NC(=O)C5CCCCC5

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C3=[NH+]C4=C(N3)C=C(C=C4)NC(=O)C5CCCCC5

InChI

InChI=1S/C27H32N4O2/c32-26(19-7-3-1-4-8-19)28-21-13-11-18(12-14-21)25-30-23-16-15-22(17-24(23)31-25)29-27(33)20-9-5-2-6-10-20/h11-17,19-20H,1-10H2,(H,28,32)(H,29,33)(H,30,31)/p+1